[[3-[bis(2-chloroethyl)amino]-4-methylphenyl]-hydroxy-phosphonomethyl]phosphonic acid
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![[[3-[bis(2-chloroethyl)amino]-4-methylphenyl]-hydroxy-phosphonomethyl]phosphonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d7f3083f289a4993bb8b37804cd588db.png "[[3-[bis(2-chloroethyl)amino]-4-methylphenyl]-hydroxy-phosphonomethyl]phosphonic acid")
[[3-[bis(2-chloroethyl)amino]-4-methylphenyl]-hydroxy-phosphonomethyl]phosphonic acid
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CAS No:
106871-13-0
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Formula:
C12H19Cl2NO7P2
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Chemical Name:
[[3-[bis(2-chloroethyl)amino]-4-methylphenyl]-hydroxy-phosphonomethyl]phosphonic acid
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Synonyms:
((3-(bis(2-chloroethyl)amino)-4-methylphenyl)hydroxymethane)bisphosphonic acid;BCMP;((3-(Bis(2-chloroethyl)amino)-4-methylphenyl)hydroxymethane)bisphosphonic acid;106871-13-0;CCRIS 1232;((3-(Bis(2-chloroethyl)amino)-4-methylphenyl)hydroxymethylene)bisphosphonic acid;[[3-[BIS(2-CHLOROETHYL)AMINO]-4-METHYLPHENYL]HYDROXYMETHYLENE]BISPHOSPHONIC ACID;3-(Bis(2-chloroethyl)amino)-4-methylphenyl-hydroxymethanbiphosphonic acid;((3-(Bis(2-chloroethyl)amino)-4-methylphenyl)hyd roxymethylene)bis-phosphonic acid;SCHEMBL15452886;DTXSID40147802;[[3-[bis(2-chloroethyl)amino]-4-methylphenyl]-hydroxy-phosphonomethyl]phosphonic acid;Phosphonic acid, ((3-(bis(2-chloroethyl)amino)-4-methylphenyl)hydroxymethylene)bis-
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CAS No:
[[3-[bis(2-chloroethyl)amino]-4-methylphenyl]-hydroxy-phosphonomethyl]phosphonic acid Basic Attributes
422.13 g/mol
421.0013813 g/mol
DTXSID40147802
Computed Properties
Molecular Weight:422.13
XLogP3:-0.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:421.0013813
Monoisotopic Mass:421.0013813
Topological Polar Surface Area:139
Heavy Atom Count:24
Complexity:484
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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